SCHEMBL6595300

SCHEMBL6595300

CS(=O)(=O)NCCn1cncc1-c1ccnc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 3/20 0.53
▸ BCR P11274 3/20 0.53
▸ PRKCA P17252 2/20 0.53
▸ PRKCD Q05655 2/20 0.53
▸ CDK2 P24941 4/20 0.49
▸ CAMK2D Q13557 5/20 0.46
▸ PTGS1 P23219 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ CDK4 P11802 2/20 0.45
▸ EIF2AK2 P19525 2/20 0.44
▸ CSNK2A1 P68400 2/20 0.44
▸ MAPT P10636 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ CCNT1 O60563 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ XBP1 P17861 1/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ CCNE1 P24864 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6106065 0.85 ABL1 (0.53) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL6106058 0.84 ABL1 (0.56) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL6594301 0.83 ABL1 (0.58) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL27533831 0.83 ABL1 (0.52) ABL1BCRPRKCAPRKCDCDK2
Hydrochloric Acid SCHEMBL6294928 0.82 ABL1 (0.53) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL6594423 0.80 ABL1 (0.62) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL6103563 0.80 ABL1 (0.53) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL27533835 0.78 ABL1 (0.52) ABL1BCRPRKCAPRKCDCDK2
SCHEMBL5104939 0.73 PRKCD (0.51) ABL1PRKCAPRKCDCDK2CAMK2D
SCHEMBL3606676 0.73 ABL1 (0.50) ABL1BCRPRKCAPRKCDCDK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1269813-C Imidazolo-5-yl-2-anilino-pyrimidines as agents for inhibition of cell proliferation ASTRAZENECA AB (SE) 2006-08-16 — — CN disclosed
EP-1351958-B1 IMIDAZOLO-5-YL-2-ANILINO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF THE CELL PROLIFERATION ASTRAZENECA AB (SE) 2004-06-16 — — EP disclosed
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